N-(4-methylphenyl)-2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-butanamide

Systemtic Name: N-(4-methylphenyl)-2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-butanamide Openeye Name: 2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(p-tolyl)butanamide CAS Name: N-(4-methylphenyl)-2-[[3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]phenyl]thio]butanamide IUPAC Name: N-(4-methylphenyl)-2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanylbutanamide Traditional Name: 2-[[3-[[(E)-3-phenylacryloyl]amino]phenyl]thio]-N-(p-tolyl)butyramide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=CC=CC(=C2)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=CC=CC(=C2)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C26H26N2O2S/c1-3-24(26(30)28-21-15-12-19(2)13-16-21)31-23-11-7-10-22(18-23)27-25(29)17-14-20-8-5-4-6-9-20/h4-18,24H,3H2,1-2H3,(H,27,29)(H,28,30)/b17-14+